2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide

C12H14N6OS — CID 175864789

IUPAC2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide
SMILESNC(=O)c1cnc(N2CCN(c3cccnn3)CC2)s1
InChIInChI=1S/C12H14N6OS/c13-11(19)9-8-14-12(20-9)18-6-4-17(5-7-18)10-2-1-3-15-16-10/h1-3,8H,4-7H2,(H2,13,19)
InChIKeyGUBQAJWUWIOEOZ-UHFFFAOYSA-N
MW290.35 g/mol
LogP0.36
Rot. Bonds3

About 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide

2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide (PubChem CID 175864789) has the molecular formula C12H14N6OS and a molecular weight of 290.35 g/mol. Its IUPAC name is 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide
PubChem CID175864789
Molecular FormulaC12H14N6OS
Molecular Weight290.35 g/mol
Exact Mass290.09
IUPAC Name2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide
SMILESNC(=O)c1cnc(N2CCN(c3cccnn3)CC2)s1
InChIInChI=1S/C12H14N6OS/c13-11(19)9-8-14-12(20-9)18-6-4-17(5-7-18)10-2-1-3-15-16-10/h1-3,8H,4-7H2,(H2,13,19)
InChIKeyGUBQAJWUWIOEOZ-UHFFFAOYSA-N
XLogP0.36
TPSA88.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.35
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(1H-pyrazol-4-yl)piperazin-1-yl]-1,3-thiazole-5-carboxamide
CID 175864765
2-(3-aminoazetidin-1-yl)-1,3-thiazole-5-carboxamide
CID 134429966
2-[4-[(3S)-3-phenyl-3,4-dihydropyrazole-2-carbonyl]piperidin-1-yl]-1,3-thiazole-5-carboxamide
CID 134521790
N-(2-hydroxyethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide
CID 117083304
3-ethyl-5-(4-pyridazin-3-ylpiperazin-1-yl)-1,2,4-thiadiazole
CID 166199012
(3-aminophenyl)-(4-pyridazin-3-ylpiperazin-1-yl)methanone
CID 119873679
N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide
CID 117082718
(4-methylphenyl)-(4-pyridazin-3-ylpiperazin-1-yl)methanone
CID 121060278
(4-fluorophenyl)-(4-pyridazin-3-ylpiperazin-1-yl)methanone
CID 121060430
2-amino-2-(oxan-4-yl)-1-(4-pyridazin-3-ylpiperazin-1-yl)ethanone
CID 120799696
1-(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)ethanone
CID 62756912
2-[4-(3-chlorophenyl)piperazin-1-yl]-1,3-thiazole-5-carboxylic acid
CID 62753823

Frequently Asked Questions

What is the IUPAC name of 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide (CID 175864789) is 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide is NC(=O)c1cnc(N2CCN(c3cccnn3)CC2)s1.
What is the InChIKey of 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is GUBQAJWUWIOEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6OS/c13-11(19)9-8-14-12(20-9)18-6-4-17(5-7-18)10-2-1-3-15-16-10/h1-3,8H,4-7H2,(H2,13,19).
What are the key properties of 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide?
2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 290.35 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyridazin-3-ylpiperazin-1-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 175864789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).